smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(CCN(C)Cc1cccnc1)Cc1ccc(F)cc1 ZINC000161020842 522810324 /nfs/dbraw/zinc/81/03/24/522810324.db2.gz ICKVUKYZJSXGAB-UHFFFAOYSA-N 0 3 287.382 2.785 10 70 CFIEHN CCn1cc(C2CCN(CCc3ccncc3)CC2)cn1 ZINC000160637335 523356807 /nfs/dbraw/zinc/35/68/07/523356807.db2.gz GLNGBEMFQCRLRB-UHFFFAOYSA-N 0 3 284.407 2.720 10 70 CFIEHN CCn1cnnc1[C@@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000161306972 523601056 /nfs/dbraw/zinc/60/10/56/523601056.db2.gz BCFRAAHZJFUZHA-CQSZACIVSA-N 0 3 288.370 2.817 10 70 CFIEHN Cc1cccc([C@@H]2CCCN2C[C@H](O)COC(C)(C)C)n1 ZINC000159801107 524850083 /nfs/dbraw/zinc/85/00/83/524850083.db2.gz CFOYUYFMOJDACN-HOCLYGCPSA-N 0 3 292.423 2.703 10 70 CFIEHN Cc1nc(C[C@H]2CCCN(Cc3ccc(F)cc3)C2)no1 ZINC000161045877 526923984 /nfs/dbraw/zinc/92/39/84/526923984.db2.gz DGXMLKAIWYLISL-CQSZACIVSA-N 0 3 289.354 2.972 10 70 CFIEHN Cn1nccc1C1CCN(Cc2cccc(F)c2)CC1 ZINC000160521147 527599340 /nfs/dbraw/zinc/59/93/40/527599340.db2.gz UPPDEZYTBVFVFW-UHFFFAOYSA-N 0 3 273.355 2.939 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H](C)c1ccc(F)cc1F)N(C)C ZINC000161246712 188517637 /nfs/dbraw/zinc/51/76/37/188517637.db2.gz REWOOSNNCGLANI-YGRLFVJLSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@H](C(=O)N[C@H](C)c1ccccc1C)N(C)C ZINC000161241895 378832473 /nfs/dbraw/zinc/83/24/73/378832473.db2.gz MMDWIPSXLWZWOV-UKRRQHHQSA-N 0 3 262.397 2.903 10 70 CFIEHN CCCCNC(=O)[C@@H](C)N[C@H](C)c1cccc(C)c1 ZINC000160226324 322334664 /nfs/dbraw/zinc/33/46/64/322334664.db2.gz KZBVDOGMHAMTFU-ZIAGYGMSSA-N 0 3 262.397 2.950 10 70 CFIEHN CCC[C@@H](N)C(=O)NCCOc1cccc(C(C)(C)C)c1 ZINC000160108339 378748353 /nfs/dbraw/zinc/74/83/53/378748353.db2.gz XEJGPRJMIZIONH-OAHLLOKOSA-N 0 3 292.423 2.607 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC000161248685 378833910 /nfs/dbraw/zinc/83/39/10/378833910.db2.gz MBLJTKYIBZNVBE-YGRLFVJLSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H](C)CCc1ccccc1)N(C)C ZINC000161170564 276282129 /nfs/dbraw/zinc/28/21/29/276282129.db2.gz WFRQEMSYXHGOQP-GOEBONIOSA-N 0 3 276.424 2.854 10 70 CFIEHN CCC[C@H](C(=O)NCC1(c2ccccc2)CCC1)N(C)C ZINC000161369861 322351048 /nfs/dbraw/zinc/35/10/48/322351048.db2.gz YPISMYIVNCRNJC-MRXNPFEDSA-N 0 3 288.435 2.955 10 70 CFIEHN COc1c(CNC[C@H]2CCC[C@H](C)C2)c(C)nn1C ZINC000218238252 521832937 /nfs/dbraw/zinc/83/29/37/521832937.db2.gz TWZKONKHZPJMSC-AAEUAGOBSA-N 0 3 265.401 2.653 10 70 CFIEHN CCn1nc(C)c([C@@H](C)NCC2(CO)CCCC2)c1C ZINC000160112590 523659696 /nfs/dbraw/zinc/65/96/96/523659696.db2.gz XHWZREXRTMJCCZ-GFCCVEGCSA-N 0 3 279.428 2.723 10 70 CFIEHN C[C@@H](N[C@@H]1CCCC[C@@H]1C)c1nnc2ccccn21 ZINC000217641027 525633713 /nfs/dbraw/zinc/63/37/13/525633713.db2.gz CXBIXMMJZIQXLV-YNEHKIRRSA-N 0 3 258.369 2.959 10 70 CFIEHN c1cc(C2CCN(Cc3ccc4c(c3)OCCO4)CC2)n[nH]1 ZINC000160546543 526418403 /nfs/dbraw/zinc/41/84/03/526418403.db2.gz KZNDEXCUIOHJGC-UHFFFAOYSA-N 0 3 299.374 2.561 10 70 CFIEHN C[C@H](N[C@H]1CCC[C@@H](O)C1)c1nc2ccccc2n1C ZINC000217642326 539660367 /nfs/dbraw/zinc/66/03/67/539660367.db2.gz PEVPSLDGRIXOMR-RWMBFGLXSA-N 0 3 273.380 2.527 10 70 CFIEHN COc1ccc(C)cc1[C@H](C)N[C@@H]1CCC[C@@H](O)C1 ZINC000217660206 539662089 /nfs/dbraw/zinc/66/20/89/539662089.db2.gz OTHPCMNCILZLNT-BFHYXJOUSA-N 0 3 263.381 2.958 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H]1CCCc2sccc21)N(C)C ZINC000159982112 188449983 /nfs/dbraw/zinc/44/99/83/188449983.db2.gz DBKPFCCIOSTALI-OLZOCXBDSA-N 0 3 280.437 2.972 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H](C)c1ccccc1C)N(C)C ZINC000161241535 378832823 /nfs/dbraw/zinc/83/28/23/378832823.db2.gz MMDWIPSXLWZWOV-ZFWWWQNUSA-N 0 3 262.397 2.903 10 70 CFIEHN CCC[C@@H](C(=O)NCCC1=CCCCC1)N(C)C ZINC000161266360 322349867 /nfs/dbraw/zinc/34/98/67/322349867.db2.gz MFMLQHMSALZULP-AWEZNQCLSA-N 0 3 252.402 2.723 10 70 CFIEHN CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1cccc(C)c1 ZINC000160231876 523986572 /nfs/dbraw/zinc/98/65/72/523986572.db2.gz FEVJPQCIOIQCEA-BFHYXJOUSA-N 0 3 262.397 2.949 10 70 CFIEHN CC(C)N(C)CC(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000159999757 378741588 /nfs/dbraw/zinc/74/15/88/378741588.db2.gz SYWLWKIIQJYHAF-AWEZNQCLSA-N 0 3 290.407 2.745 10 70 CFIEHN CC[C@@H](C(=O)N[C@H]1CC(C)(C)Oc2ccccc21)N(C)C ZINC000159551286 276409086 /nfs/dbraw/zinc/40/90/86/276409086.db2.gz NKBSRYRMJCCAFA-KBPBESRZSA-N 0 3 290.407 2.745 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H]1CCCc2ccccc21)N(C)C ZINC000160366033 322336764 /nfs/dbraw/zinc/33/67/64/322336764.db2.gz XLSBUBWQZJASDL-HOTGVXAUSA-N 0 3 274.408 2.911 10 70 CFIEHN O=C(NCCN1CCCCC1)[C@@H]1C[C@H]1C1CCCCC1 ZINC000160572265 322340079 /nfs/dbraw/zinc/34/00/79/322340079.db2.gz BSPBFVBUAOOIME-JKSUJKDBSA-N 0 3 278.440 2.805 10 70 CFIEHN CC(C)N1C[C@H](NC(=O)c2cccc3[nH]ccc32)[C@@H](C)C1 ZINC000161382815 322350717 /nfs/dbraw/zinc/35/07/17/322350717.db2.gz GIIUXAVZUZVLRA-LRDDRELGSA-N 0 3 285.391 2.626 10 70 CFIEHN CCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccccc1C)CC2 ZINC000159603880 522523438 /nfs/dbraw/zinc/52/34/38/522523438.db2.gz HIPBWMXZMZEUSL-KBPBESRZSA-N 0 3 284.407 2.815 10 70 CFIEHN CC[C@H]1CN2CCCC[C@@H]2CN1CCc1csc(C)n1 ZINC000218134945 523310396 /nfs/dbraw/zinc/31/03/96/523310396.db2.gz PQHUZIXYAYBCBH-JKSUJKDBSA-N 0 3 293.480 2.943 10 70 CFIEHN Cc1cccc([C@H](C)N[C@H](C)C(=O)NCC(C)C)c1 ZINC000160251377 524875914 /nfs/dbraw/zinc/87/59/14/524875914.db2.gz VEBTVXCHZWQWSD-UONOGXRCSA-N 0 3 262.397 2.806 10 70 CFIEHN COc1cccc(CN2CCC(c3cc[nH]n3)CC2)c1 ZINC000160655629 525935812 /nfs/dbraw/zinc/93/58/12/525935812.db2.gz PRNKDFPURNGGLB-UHFFFAOYSA-N 0 3 271.364 2.798 10 70 CFIEHN Cc1nc(CCN2C[C@@H]3CCCCN3C[C@@H]2C)cs1 ZINC000218133489 526814161 /nfs/dbraw/zinc/81/41/61/526814161.db2.gz PTUIRIWDHJORTB-WFASDCNBSA-N 0 3 279.453 2.553 10 70 CFIEHN Cc1nccn1C[C@H]1CCCN1Cc1cnc2ccccn12 ZINC000160964414 527448986 /nfs/dbraw/zinc/44/89/86/527448986.db2.gz BHWLRHBMOSWVDJ-OAHLLOKOSA-N 0 3 295.390 2.504 10 70 CFIEHN O=C(NC1CCN(C2CC2)CC1)[C@H]1C[C@@H]1C1CCCCC1 ZINC000159371901 527525426 /nfs/dbraw/zinc/52/54/26/527525426.db2.gz PLWFRQPWVJASJL-SJORKVTESA-N 0 3 290.451 2.946 10 70 CFIEHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000159372173 283928060 /nfs/dbraw/zinc/92/80/60/283928060.db2.gz PLWFRQPWVJASJL-IAGOWNOFSA-N 0 3 290.451 2.946 10 70 CFIEHN C[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C)c1cccs1 ZINC000160268829 378760991 /nfs/dbraw/zinc/76/09/91/378760991.db2.gz XUEMWLHZVDLJQI-FRRDWIJNSA-N 0 3 278.421 2.547 10 70 CFIEHN CCCN(CC(=O)Nc1ccccc1C)C[C@@](C)(O)CC ZINC000160462924 378774362 /nfs/dbraw/zinc/77/43/62/378774362.db2.gz KGTSYYHKFLSFDH-KRWDZBQOSA-N 0 3 292.423 2.807 10 70 CFIEHN CCC[C@H](C(=O)N[C@H](C)c1ccc(F)c(F)c1)N(C)C ZINC000161248789 378833640 /nfs/dbraw/zinc/83/36/40/378833640.db2.gz MBLJTKYIBZNVBE-QMTHXVAHSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@H](N)C(=O)Nc1ccccc1OC(C)(C)C ZINC000160945535 378811680 /nfs/dbraw/zinc/81/16/80/378811680.db2.gz BFLIBKJHYOFIFB-NSHDSACASA-N 0 3 264.369 2.930 10 70 CFIEHN CN(CCN(C)[C@@H]1CCSC1)Cc1ccc(F)cc1 ZINC000161049299 378817788 /nfs/dbraw/zinc/81/77/88/378817788.db2.gz KLFAGJISGBNVCR-OAHLLOKOSA-N 0 3 282.428 2.695 10 70 CFIEHN CC(C)N(C)CC(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000159999613 394365931 /nfs/dbraw/zinc/36/59/31/394365931.db2.gz SYWLWKIIQJYHAF-CQSZACIVSA-N 0 3 290.407 2.745 10 70 CFIEHN C[C@H]1C[C@H](NC[C@H]2CN(C)CCO2)c2ccsc2S1 ZINC000217001359 280011224 /nfs/dbraw/zinc/01/12/24/280011224.db2.gz HNOKDQHVVDLIJJ-GVXVVHGQSA-N 0 3 298.477 2.594 10 70 CFIEHN CCC[C@@H](C(=O)NCCCC1CCCC1)N(C)C ZINC000161457733 322351897 /nfs/dbraw/zinc/35/18/97/322351897.db2.gz IKHIFGNJVYDSDU-AWEZNQCLSA-N 0 3 254.418 2.803 10 70 CFIEHN CCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccccc1C)CC2 ZINC000159603748 522531069 /nfs/dbraw/zinc/53/10/69/522531069.db2.gz HIPBWMXZMZEUSL-UONOGXRCSA-N 0 3 284.407 2.815 10 70 CFIEHN COc1ccc(CN2CCC(c3ccnn3C)CC2)cc1 ZINC000160519081 524025742 /nfs/dbraw/zinc/02/57/42/524025742.db2.gz WCSWKDUXPJZCJJ-UHFFFAOYSA-N 0 3 285.391 2.808 10 70 CFIEHN Cc1nc(C[C@@H]2CCCN(Cc3ccc(F)cc3)C2)no1 ZINC000161045763 526920515 /nfs/dbraw/zinc/92/05/15/526920515.db2.gz DGXMLKAIWYLISL-AWEZNQCLSA-N 0 3 289.354 2.972 10 70 CFIEHN CCC[C@@H](N)C(=O)Nc1ccccc1OC(C)(C)C ZINC000160945661 378812140 /nfs/dbraw/zinc/81/21/40/378812140.db2.gz BFLIBKJHYOFIFB-LLVKDONJSA-N 0 3 264.369 2.930 10 70 CFIEHN CCC[C@H](NCCn1cc(C)cn1)c1ccccn1 ZINC000159393386 322322259 /nfs/dbraw/zinc/32/22/59/322322259.db2.gz LIWQQHOVQKDMNA-AWEZNQCLSA-N 0 3 258.369 2.718 10 70 CFIEHN CCC[C@H](C(=O)NCCCC1CCCC1)N(C)C ZINC000161457845 322352055 /nfs/dbraw/zinc/35/20/55/322352055.db2.gz IKHIFGNJVYDSDU-CQSZACIVSA-N 0 3 254.418 2.803 10 70 CFIEHN COC(=O)c1ccc(CN2CCC(c3cc[nH]n3)CC2)cc1 ZINC000160533400 522005041 /nfs/dbraw/zinc/00/50/41/522005041.db2.gz XWXCPXKVUIINRA-UHFFFAOYSA-N 0 3 299.374 2.576 10 70 CFIEHN Cc1nc(C[C@H]2CCCN(Cc3cccc(F)c3)C2)no1 ZINC000161047480 526923661 /nfs/dbraw/zinc/92/36/61/526923661.db2.gz CRGXOYVLYDBKTL-CQSZACIVSA-N 0 3 289.354 2.972 10 70 CFIEHN CCCn1nccc1CN[C@H](CN(C)C)c1ccccc1 ZINC000159981176 540666188 /nfs/dbraw/zinc/66/61/88/540666188.db2.gz MVUCGFXQHZQOMK-QGZVFWFLSA-N 0 3 286.423 2.686 10 70 CFIEHN CCC[C@H](N)C(=O)NCCOc1cccc(C(C)(C)C)c1 ZINC000160108219 378749006 /nfs/dbraw/zinc/74/90/06/378749006.db2.gz XEJGPRJMIZIONH-HNNXBMFYSA-N 0 3 292.423 2.607 10 70 CFIEHN CCC[C@H](C(=O)NCc1ccccc1COCC)N(C)C ZINC000161498558 378850975 /nfs/dbraw/zinc/85/09/75/378850975.db2.gz MDKXRAFZZHAEDT-MRXNPFEDSA-N 0 3 292.423 2.570 10 70 CFIEHN CCC[C@@H](C(=O)N1CCC[C@@H](CC)CC1)N(C)C ZINC000160791645 322343136 /nfs/dbraw/zinc/34/31/36/322343136.db2.gz OOZWKOFUQSRLPN-KGLIPLIRSA-N 0 3 254.418 2.755 10 70 CFIEHN CCC[C@H](C(=O)N[C@H](C)c1ccc(OC)c(F)c1)N(C)C ZINC000161284641 322349890 /nfs/dbraw/zinc/34/98/90/322349890.db2.gz SEYGJIZNGAVRJI-BXUZGUMPSA-N 0 3 296.386 2.742 10 70 CFIEHN CCC[C@@H](C(=O)NCc1ccc(C)cc1C)N(C)C ZINC000161478500 322352319 /nfs/dbraw/zinc/35/23/19/322352319.db2.gz POHRHDMLJRCIEO-HNNXBMFYSA-N 0 3 262.397 2.650 10 70 CFIEHN CCn1cnnc1[C@H]1CCCN(CCOCCC(C)C)C1 ZINC000161412066 523604227 /nfs/dbraw/zinc/60/42/27/523604227.db2.gz VRLCXIPDAAROMQ-HNNXBMFYSA-N 0 3 294.443 2.540 10 70 CFIEHN CCn1cnnc1[C@H]1CCCN(Cc2ccccc2)C1 ZINC000161338333 523607071 /nfs/dbraw/zinc/60/70/71/523607071.db2.gz XTKXLDHIFHXACU-HNNXBMFYSA-N 0 3 270.380 2.678 10 70 CFIEHN Cc1ccc(C(=O)CCN2CC[C@H](c3cnn(C)c3)C2)cc1 ZINC000159718901 378726557 /nfs/dbraw/zinc/72/65/57/378726557.db2.gz PUCNRLWROLIVHK-INIZCTEOSA-N 0 3 297.402 2.791 10 70 CFIEHN Cc1cccc([C@@H](C)NCC(=O)N[C@@H](C)C(C)C)c1 ZINC000160238694 322335013 /nfs/dbraw/zinc/33/50/13/322335013.db2.gz URBDGDRRLLYHCD-UONOGXRCSA-N 0 3 262.397 2.806 10 70 CFIEHN CCC[C@H](C(=O)N1CCC[C@@H](CC)CC1)N(C)C ZINC000160791785 322343063 /nfs/dbraw/zinc/34/30/63/322343063.db2.gz OOZWKOFUQSRLPN-ZIAGYGMSSA-N 0 3 254.418 2.755 10 70 CFIEHN CCC[C@@H](C(=O)NCCc1cc2ccccc2[nH]1)N(C)C ZINC000161445019 322351849 /nfs/dbraw/zinc/35/18/49/322351849.db2.gz MFUYOZLNRCWIPN-INIZCTEOSA-N 0 3 287.407 2.557 10 70 CFIEHN COc1c(CNCCCC2CCCC2)c(C)nn1C ZINC000218213374 521833925 /nfs/dbraw/zinc/83/39/25/521833925.db2.gz HDIGPMDCTLUQOQ-UHFFFAOYSA-N 0 3 265.401 2.797 10 70 CFIEHN CCn1cc(C2CCN(Cc3cccnc3)CC2)cn1 ZINC000160469489 523357879 /nfs/dbraw/zinc/35/78/79/523357879.db2.gz BGDAETSHXGUFSQ-UHFFFAOYSA-N 0 3 270.380 2.678 10 70 CFIEHN CCN1CCO[C@H](CN[C@H](C)c2ccc(Cl)cc2)C1 ZINC000159983956 348015316 /nfs/dbraw/zinc/01/53/16/348015316.db2.gz DYZDMQHUXSETJR-IUODEOHRSA-N 0 3 282.815 2.711 10 70 CFIEHN O=C(NC1CCN(C2CC2)CC1)[C@H]1C[C@H]1C1CCCCC1 ZINC000159371785 378705728 /nfs/dbraw/zinc/70/57/28/378705728.db2.gz PLWFRQPWVJASJL-IRXDYDNUSA-N 0 3 290.451 2.946 10 70 CFIEHN Cc1ccc(C(=O)CCN2CC[C@@H](c3cnn(C)c3)C2)cc1 ZINC000159719106 378726174 /nfs/dbraw/zinc/72/61/74/378726174.db2.gz PUCNRLWROLIVHK-MRXNPFEDSA-N 0 3 297.402 2.791 10 70 CFIEHN CCN(CC)CC(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000159989866 276095206 /nfs/dbraw/zinc/09/52/06/276095206.db2.gz FWNDLKZSKKXROB-AWEZNQCLSA-N 0 3 290.407 2.747 10 70 CFIEHN CCN1CCC[C@H](NC(=O)c2ccc(F)c(SC)c2)C1 ZINC000160989178 322346068 /nfs/dbraw/zinc/34/60/68/322346068.db2.gz LTDRACMYGRJGMB-LBPRGKRZSA-N 0 3 296.411 2.762 10 70 CFIEHN CCC[C@H](C(=O)NCCCOC1CCCCC1)N(C)C ZINC000161293395 322349901 /nfs/dbraw/zinc/34/99/01/322349901.db2.gz SSPLPBPYNQMJEU-OAHLLOKOSA-N 0 3 284.444 2.572 10 70 CFIEHN CCCN1CCCN(c2nc(C(C)(C)C)ns2)CC1 ZINC000159444791 519852032 /nfs/dbraw/zinc/85/20/32/519852032.db2.gz RUMFYBXHWJJDKX-UHFFFAOYSA-N 0 3 282.457 2.758 10 70 CFIEHN CC[C@@H]1CN2CCCC[C@@H]2CN1CCc1csc(C)n1 ZINC000218134865 523476949 /nfs/dbraw/zinc/47/69/49/523476949.db2.gz PQHUZIXYAYBCBH-HZPDHXFCSA-N 0 3 293.480 2.943 10 70 CFIEHN Cc1cccc(NC[C@@H]2CCN(CCOCC3CC3)C2)n1 ZINC000160088232 524680323 /nfs/dbraw/zinc/68/03/23/524680323.db2.gz XQTNUUJBUAKCGK-INIZCTEOSA-N 0 3 289.423 2.550 10 70 CFIEHN Cn1c(CN2CCC(c3ccn[nH]3)CC2)nc2ccccc21 ZINC000160545717 527051848 /nfs/dbraw/zinc/05/18/48/527051848.db2.gz MQIIPQVUCXZNIY-UHFFFAOYSA-N 0 3 295.390 2.676 10 70 CFIEHN CCC[C@@H](C(=O)N(C)Cc1cccc(F)c1)N(C)C ZINC000161215638 322348758 /nfs/dbraw/zinc/34/87/58/322348758.db2.gz OISGWUJISHLIPZ-AWEZNQCLSA-N 0 3 266.360 2.514 10 70 CFIEHN CCC[C@@H](C(=O)NCCCOC1CCCCC1)N(C)C ZINC000161293279 322350017 /nfs/dbraw/zinc/35/00/17/322350017.db2.gz SSPLPBPYNQMJEU-HNNXBMFYSA-N 0 3 284.444 2.572 10 70 CFIEHN COc1cc(C)ccc1[C@H](C)N[C@@H]1CCC[C@@H](O)C1 ZINC000218304046 539690721 /nfs/dbraw/zinc/69/07/21/539690721.db2.gz PVKNKGOBITWONT-BFHYXJOUSA-N 0 3 263.381 2.958 10 70 CFIEHN CC[C@@H](C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21)N(C)C ZINC000159551015 378715281 /nfs/dbraw/zinc/71/52/81/378715281.db2.gz NKBSRYRMJCCAFA-KGLIPLIRSA-N 0 3 290.407 2.745 10 70 CFIEHN CCC[C@@H](C(=O)NCCSc1ccccc1)N(C)C ZINC000161274858 378836274 /nfs/dbraw/zinc/83/62/74/378836274.db2.gz GBUILSMDGXJDPQ-AWEZNQCLSA-N 0 3 280.437 2.625 10 70 CFIEHN CCC[C@H](C(=O)N[C@H](C)c1ccc(F)cc1F)N(C)C ZINC000161246847 378832554 /nfs/dbraw/zinc/83/25/54/378832554.db2.gz REWOOSNNCGLANI-QMTHXVAHSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@@H](C(=O)NCC(C)(C)c1ccccc1)N(C)C ZINC000161509975 322352962 /nfs/dbraw/zinc/35/29/62/322352962.db2.gz LLFMKTZRAKYVPA-HNNXBMFYSA-N 0 3 276.424 2.811 10 70 CFIEHN C[C@H]1C[C@@H](NC[C@H]2CN(C)CCO2)c2ccsc2S1 ZINC000217001366 393756018 /nfs/dbraw/zinc/75/60/18/393756018.db2.gz HNOKDQHVVDLIJJ-GMXVVIOVSA-N 0 3 298.477 2.594 10 70 CFIEHN CCCCNC(=O)[C@H](C)N[C@@H](C)c1cccc(C)c1 ZINC000160252047 322335352 /nfs/dbraw/zinc/33/53/52/322335352.db2.gz KZBVDOGMHAMTFU-KBPBESRZSA-N 0 3 262.397 2.950 10 70 CFIEHN CCC[C@H](C(=O)NCCc1ccc(Cl)cc1)N(C)C ZINC000161183633 322348743 /nfs/dbraw/zinc/34/87/43/322348743.db2.gz BEOFHMVIZBILIE-CQSZACIVSA-N 0 3 282.815 2.729 10 70 CFIEHN CCC[C@H](C(=O)NCCc1cccc(Cl)c1)N(C)C ZINC000161258613 322349247 /nfs/dbraw/zinc/34/92/47/322349247.db2.gz VVWXYXZVPUELPY-CQSZACIVSA-N 0 3 282.815 2.729 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H](C)c1ccc(OC)c(F)c1)N(C)C ZINC000161284392 322349928 /nfs/dbraw/zinc/34/99/28/322349928.db2.gz SEYGJIZNGAVRJI-SMDDNHRTSA-N 0 3 296.386 2.742 10 70 CFIEHN CCOC(=O)C[C@@H](N)c1ccc(Br)c(F)c1 ZINC000161483601 348024755 /nfs/dbraw/zinc/02/47/55/348024755.db2.gz VWOFFYBXXUFJKE-SNVBAGLBSA-N 0 3 290.132 2.541 10 70 CFIEHN COc1ccc(OC)c([C@H](C)N[C@@H]2CCC[C@@H](O)C2)c1 ZINC000217662622 539662026 /nfs/dbraw/zinc/66/20/26/539662026.db2.gz BXIRGJYVOJQMOA-YNEHKIRRSA-N 0 3 279.380 2.658 10 70 CFIEHN CCC[C@H](C(=O)N(CC)Cc1cccs1)N(C)C ZINC000161445103 188528765 /nfs/dbraw/zinc/52/87/65/188528765.db2.gz SLBOZXAUDVNRNC-CYBMUJFWSA-N 0 3 268.426 2.827 10 70 CFIEHN CCC[C@@H](C(=O)NCC1(c2ccccc2)CCC1)N(C)C ZINC000161369736 322350873 /nfs/dbraw/zinc/35/08/73/322350873.db2.gz YPISMYIVNCRNJC-INIZCTEOSA-N 0 3 288.435 2.955 10 70 CFIEHN CCC[C@H](C(=O)NC[C@H]1CCCc2ccccc21)N(C)C ZINC000161454719 322352018 /nfs/dbraw/zinc/35/20/18/322352018.db2.gz ANECPSXBYAACAK-NVXWUHKLSA-N 0 3 288.435 2.953 10 70 CFIEHN CCN1CCO[C@@H](CNCc2c(C)oc3ccccc32)C1 ZINC000160792792 541479828 /nfs/dbraw/zinc/47/98/28/541479828.db2.gz QBMQATHWYOKHFH-AWEZNQCLSA-N 0 3 288.391 2.552 10 70 CFIEHN C[C@H](C(=O)N1C[C@H]2CCCN2C[C@@H]1C)c1cccs1 ZINC000160268956 378761114 /nfs/dbraw/zinc/76/11/14/378761114.db2.gz XUEMWLHZVDLJQI-RWMBFGLXSA-N 0 3 278.421 2.547 10 70 CFIEHN CCC[C@H](C(=O)NCc1ccc(COCC)cc1)N(C)C ZINC000161495768 378851595 /nfs/dbraw/zinc/85/15/95/378851595.db2.gz NCAKSYWRPRPHOR-MRXNPFEDSA-N 0 3 292.423 2.570 10 70 CFIEHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)C1CCC(C)(C)CC1 ZINC000160386459 322337318 /nfs/dbraw/zinc/33/73/18/322337318.db2.gz MKWPZCBTNZVOKZ-UKRRQHHQSA-N 0 3 278.440 2.898 10 70 CFIEHN CCC[C@H](C(=O)NCCC1=CCCCC1)N(C)C ZINC000161266466 322349988 /nfs/dbraw/zinc/34/99/88/322349988.db2.gz MFMLQHMSALZULP-CQSZACIVSA-N 0 3 252.402 2.723 10 70 CFIEHN CCC[C@H](C(=O)N(C)CCOc1ccc(C)cc1)N(C)C ZINC000161332694 322350475 /nfs/dbraw/zinc/35/04/75/322350475.db2.gz ZMXHIHVVDZQGBV-MRXNPFEDSA-N 0 3 292.423 2.563 10 70 CFIEHN CCn1cnnc1[C@@H]1CCCN(Cc2ccc(F)cc2)C1 ZINC000161339044 523600769 /nfs/dbraw/zinc/60/07/69/523600769.db2.gz WJTXNNMZABGWDC-CQSZACIVSA-N 0 3 288.370 2.817 10 70 CFIEHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1C[C@H]1C1CCCCC1 ZINC000159372042 527525776 /nfs/dbraw/zinc/52/57/76/527525776.db2.gz PLWFRQPWVJASJL-DLBZAZTESA-N 0 3 290.451 2.946 10 70 CFIEHN COc1ccc([C@H](C)N[C@H]2CCC[C@@H](O)C2)c(F)c1 ZINC000218300720 539690351 /nfs/dbraw/zinc/69/03/51/539690351.db2.gz MYUJRCIRJNCCIV-SDDRHHMPSA-N 0 3 267.344 2.788 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H](C)c1ccc(F)cc1F)N(C)C ZINC000161246480 378833054 /nfs/dbraw/zinc/83/30/54/378833054.db2.gz REWOOSNNCGLANI-HZMBPMFUSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@H](C(=O)N[C@H]1CCCc2ccccc21)N(C)C ZINC000160366138 322336796 /nfs/dbraw/zinc/33/67/96/322336796.db2.gz XLSBUBWQZJASDL-JKSUJKDBSA-N 0 3 274.408 2.911 10 70 CFIEHN CCC[C@H](C(=O)NCC(C)(C)c1ccccc1)N(C)C ZINC000161510048 322352993 /nfs/dbraw/zinc/35/29/93/322352993.db2.gz LLFMKTZRAKYVPA-OAHLLOKOSA-N 0 3 276.424 2.811 10 70 CFIEHN Cc1cccc([C@H]2CCCN2C[C@H](O)COC(C)(C)C)n1 ZINC000159801225 524896631 /nfs/dbraw/zinc/89/66/31/524896631.db2.gz CFOYUYFMOJDACN-GOEBONIOSA-N 0 3 292.423 2.703 10 70 CFIEHN C[C@H](N[C@@H]1CCC[C@@H](O)C1)c1nc2ccccc2n1C ZINC000217642152 539660358 /nfs/dbraw/zinc/66/03/58/539660358.db2.gz PEVPSLDGRIXOMR-YNEHKIRRSA-N 0 3 273.380 2.527 10 70 CFIEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc3cc[nH]c32)C1 ZINC000161342160 378841125 /nfs/dbraw/zinc/84/11/25/378841125.db2.gz QXARSRFMPXZCRS-DOMZBBRYSA-N 0 3 285.391 2.626 10 70 CFIEHN CC[C@](C)(O)CN1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000161497159 281292163 /nfs/dbraw/zinc/29/21/63/281292163.db2.gz WILBAKTUXLRKDM-ABHNRTSZSA-N 0 3 296.499 2.980 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H]1CCCc2ccccc21)N(C)C ZINC000160365823 322336900 /nfs/dbraw/zinc/33/69/00/322336900.db2.gz XLSBUBWQZJASDL-CVEARBPZSA-N 0 3 274.408 2.911 10 70 CFIEHN O[C@]12CCCC[C@@H]1CN(CCOc1cccc(F)c1)CC2 ZINC000160772086 322343123 /nfs/dbraw/zinc/34/31/23/322343123.db2.gz SVHSZFVJBZVBOX-PBHICJAKSA-N 0 3 293.382 2.832 10 70 CFIEHN COc1c(CNC[C@@H]2CCC[C@@H](C)C2)c(C)nn1C ZINC000218238006 521834634 /nfs/dbraw/zinc/83/46/34/521834634.db2.gz TWZKONKHZPJMSC-DGCLKSJQSA-N 0 3 265.401 2.653 10 70 CFIEHN CCC[C@H](C(=O)N[C@H]1CCCc2sccc21)N(C)C ZINC000159982476 378741890 /nfs/dbraw/zinc/74/18/90/378741890.db2.gz DBKPFCCIOSTALI-QWHCGFSZSA-N 0 3 280.437 2.972 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC000161248597 378833797 /nfs/dbraw/zinc/83/37/97/378833797.db2.gz MBLJTKYIBZNVBE-IINYFYTJSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@H](C(=O)NCc1nc2ccccc2s1)N(C)C ZINC000161415451 378844098 /nfs/dbraw/zinc/84/40/98/378844098.db2.gz BHNGPWABFJGMDV-GFCCVEGCSA-N 0 3 291.420 2.643 10 70 CFIEHN CCC[C@@H](C(=O)NCCc1ccc(Cl)cc1)N(C)C ZINC000161183489 322348709 /nfs/dbraw/zinc/34/87/09/322348709.db2.gz BEOFHMVIZBILIE-AWEZNQCLSA-N 0 3 282.815 2.729 10 70 CFIEHN CC(C)C[C@H](CN(C)C)NC(=O)C1CCC(F)(F)CC1 ZINC000160248632 322335294 /nfs/dbraw/zinc/33/52/94/322335294.db2.gz HPFGIUUQXIVKES-CYBMUJFWSA-N 0 3 290.398 2.904 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H](C)c1ccc(OC)c(F)c1)N(C)C ZINC000161284286 322349711 /nfs/dbraw/zinc/34/97/11/322349711.db2.gz SEYGJIZNGAVRJI-FZMZJTMJSA-N 0 3 296.386 2.742 10 70 CFIEHN CCn1cnnc1[C@H]1CCCN(Cc2ccc(F)cc2)C1 ZINC000161339176 523606755 /nfs/dbraw/zinc/60/67/55/523606755.db2.gz WJTXNNMZABGWDC-AWEZNQCLSA-N 0 3 288.370 2.817 10 70 CFIEHN CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1cccc(C)c1 ZINC000160232157 523994334 /nfs/dbraw/zinc/99/43/34/523994334.db2.gz FEVJPQCIOIQCEA-MJBXVCDLSA-N 0 3 262.397 2.949 10 70 CFIEHN Fc1cccc(CN2CCC(c3cc[nH]n3)CC2)c1 ZINC000160539325 526384711 /nfs/dbraw/zinc/38/47/11/526384711.db2.gz PTHZPUDFWPHVIZ-UHFFFAOYSA-N 0 3 259.328 2.928 10 70 CFIEHN Cn1nccc1C1CCN(Cc2ccccc2)CC1 ZINC000160524625 527599668 /nfs/dbraw/zinc/59/96/68/527599668.db2.gz DVVDECXGYYCPTI-UHFFFAOYSA-N 0 3 255.365 2.800 10 70 CFIEHN CCOC(=O)C[C@H](N)c1ccc(Br)c(F)c1 ZINC000161483462 348024601 /nfs/dbraw/zinc/02/46/01/348024601.db2.gz VWOFFYBXXUFJKE-JTQLQIEISA-N 0 3 290.132 2.541 10 70 CFIEHN O[C@@H]1CCCC[C@@H]1CN[C@@H]1CCCc2cccnc21 ZINC000217744692 539665980 /nfs/dbraw/zinc/66/59/80/539665980.db2.gz TZADZTCWOZQMOW-RBSFLKMASA-N 0 3 260.381 2.600 10 70 CFIEHN CN(Cc1ccc2ccccc2n1)C[C@H]1CCC[C@@H]1O ZINC000159476863 378712699 /nfs/dbraw/zinc/71/26/99/378712699.db2.gz IJCRDYVQQNVRMV-PBHICJAKSA-N 0 3 270.376 2.828 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H](C)c1ccc(F)c(F)c1)N(C)C ZINC000161248482 378834227 /nfs/dbraw/zinc/83/42/27/378834227.db2.gz MBLJTKYIBZNVBE-HZMBPMFUSA-N 0 3 284.350 2.872 10 70 CFIEHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cccc3[nH]ccc32)C1 ZINC000161382719 322350767 /nfs/dbraw/zinc/35/07/67/322350767.db2.gz GIIUXAVZUZVLRA-WBMJQRKESA-N 0 3 285.391 2.626 10 70 CFIEHN CCC[C@@H](C(=O)NC[C@@H]1CCCc2ccccc21)N(C)C ZINC000161454339 322352049 /nfs/dbraw/zinc/35/20/49/322352049.db2.gz ANECPSXBYAACAK-RDJZCZTQSA-N 0 3 288.435 2.953 10 70 CFIEHN CCc1noc(C)c1CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161015346 522839861 /nfs/dbraw/zinc/83/98/61/522839861.db2.gz QOBSUZLEUGJGTB-CZUORRHYSA-N 0 3 278.396 2.672 10 70 CFIEHN CCn1cnnc1[C@H]1CCCN(Cc2cccc(F)c2)C1 ZINC000161307082 523607419 /nfs/dbraw/zinc/60/74/19/523607419.db2.gz BCFRAAHZJFUZHA-AWEZNQCLSA-N 0 3 288.370 2.817 10 70 CFIEHN Cn1nccc1C1CCN(Cc2ccc(F)cc2)CC1 ZINC000160525172 527599378 /nfs/dbraw/zinc/59/93/78/527599378.db2.gz WDCCFAXYLREJQS-UHFFFAOYSA-N 0 3 273.355 2.939 10 70 CFIEHN COc1cc(C)ccc1[C@H](C)N[C@H]1CCC[C@@H](O)C1 ZINC000218304153 539690733 /nfs/dbraw/zinc/69/07/33/539690733.db2.gz PVKNKGOBITWONT-MELADBBJSA-N 0 3 263.381 2.958 10 70 CFIEHN CCC[C@@H](C(=O)NCc1nc2ccccc2s1)N(C)C ZINC000161415337 188526085 /nfs/dbraw/zinc/52/60/85/188526085.db2.gz BHNGPWABFJGMDV-LBPRGKRZSA-N 0 3 291.420 2.643 10 70 CFIEHN CCCn1nccc1CN[C@@H](CN(C)C)c1ccccc1 ZINC000159981075 540666451 /nfs/dbraw/zinc/66/64/51/540666451.db2.gz MVUCGFXQHZQOMK-KRWDZBQOSA-N 0 3 286.423 2.686 10 70 CFIEHN C[C@@H](N[C@H]1CCCC[C@@H]1C)c1nnc2ccccn21 ZINC000217641116 296162280 /nfs/dbraw/zinc/16/22/80/296162280.db2.gz CXBIXMMJZIQXLV-XQQFMLRXSA-N 0 3 258.369 2.959 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H](C)c1ccccc1C)N(C)C ZINC000161241770 378833141 /nfs/dbraw/zinc/83/31/41/378833141.db2.gz MMDWIPSXLWZWOV-HIFRSBDPSA-N 0 3 262.397 2.903 10 70 CFIEHN CCC[C@H](C(=O)NCc1cccc(Cl)c1)N(C)C ZINC000161173980 378827512 /nfs/dbraw/zinc/82/75/12/378827512.db2.gz BGGATUADIGLIDW-CYBMUJFWSA-N 0 3 268.788 2.687 10 70 CFIEHN CC(C)C[C@@H](CN(C)C)NC(=O)c1cnc(C(C)C)s1 ZINC000160363729 322336954 /nfs/dbraw/zinc/33/69/54/322336954.db2.gz HYXVIQJDDTULSO-LBPRGKRZSA-N 0 3 297.468 2.973 10 70 CFIEHN CCC[C@@H](NCCn1cc(C)cn1)c1ccccn1 ZINC000159393487 322322510 /nfs/dbraw/zinc/32/25/10/322322510.db2.gz LIWQQHOVQKDMNA-CQSZACIVSA-N 0 3 258.369 2.718 10 70 CFIEHN Cc1cccc([C@@H](C)NC[C@H](O)COC(C)(C)C)c1 ZINC000160240361 322335229 /nfs/dbraw/zinc/33/52/29/322335229.db2.gz RWNRDJMRKQIXCG-HIFRSBDPSA-N 0 3 265.397 2.822 10 70 CFIEHN CCC[C@H](C(=O)N(C)Cc1cccc(F)c1)N(C)C ZINC000161215756 322348812 /nfs/dbraw/zinc/34/88/12/322348812.db2.gz OISGWUJISHLIPZ-CQSZACIVSA-N 0 3 266.360 2.514 10 70 CFIEHN CCC[C@@H](C(=O)N(C)CCOc1ccc(C)cc1)N(C)C ZINC000161332556 322350435 /nfs/dbraw/zinc/35/04/35/322350435.db2.gz ZMXHIHVVDZQGBV-INIZCTEOSA-N 0 3 292.423 2.563 10 70 CFIEHN CCC[C@H](C(=O)N(C)CCOc1ccccc1C)N(C)C ZINC000161333787 322350517 /nfs/dbraw/zinc/35/05/17/322350517.db2.gz VMFJNXHQFNEGNM-OAHLLOKOSA-N 0 3 292.423 2.563 10 70 CFIEHN Cc1cccc(NC[C@H]2CCN(CCOCC3CC3)C2)n1 ZINC000160088356 524684223 /nfs/dbraw/zinc/68/42/23/524684223.db2.gz XQTNUUJBUAKCGK-MRXNPFEDSA-N 0 3 289.423 2.550 10 70 CFIEHN Cc1cccc([C@@H](C)N[C@@H](C)C(=O)NCC(C)C)c1 ZINC000160225595 524828308 /nfs/dbraw/zinc/82/83/08/524828308.db2.gz VEBTVXCHZWQWSD-KGLIPLIRSA-N 0 3 262.397 2.806 10 70 CFIEHN Cc1cccc([C@@H](C)N[C@H](C)C(=O)NCC(C)C)c1 ZINC000160225729 524830964 /nfs/dbraw/zinc/83/09/64/524830964.db2.gz VEBTVXCHZWQWSD-ZIAGYGMSSA-N 0 3 262.397 2.806 10 70 CFIEHN Cc1nc(C[C@@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000161045498 526919044 /nfs/dbraw/zinc/91/90/44/526919044.db2.gz LNCXYOGBDZPTJA-HNNXBMFYSA-N 0 3 271.364 2.833 10 70 CFIEHN CCC[C@H](C(=O)NCCc1c[nH]c2ccccc12)N(C)C ZINC000161181933 378828991 /nfs/dbraw/zinc/82/89/91/378828991.db2.gz RUHRWSONGSPPEE-MRXNPFEDSA-N 0 3 287.407 2.557 10 70 CFIEHN CC[C@@](C)(O)CN1CCN(C2CCC(C(C)C)CC2)CC1 ZINC000161497270 378850600 /nfs/dbraw/zinc/85/06/00/378850600.db2.gz WILBAKTUXLRKDM-DAWZGUTISA-N 0 3 296.499 2.980 10 70 CFIEHN CCc1nc(CN2CCC(c3ccn[nH]3)CC2)cs1 ZINC000160552652 522302884 /nfs/dbraw/zinc/30/28/84/522302884.db2.gz PGVKGOSZXAYIJO-UHFFFAOYSA-N 0 3 276.409 2.808 10 70 CFIEHN CCc1noc(C)c1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000161015478 522838029 /nfs/dbraw/zinc/83/80/29/522838029.db2.gz QOBSUZLEUGJGTB-CJNGLKHVSA-N 0 3 278.396 2.672 10 70 CFIEHN CCn1cnnc1[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000161338203 523601193 /nfs/dbraw/zinc/60/11/93/523601193.db2.gz XTKXLDHIFHXACU-OAHLLOKOSA-N 0 3 270.380 2.678 10 70 CFIEHN CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(Cl)nc1C ZINC000159999476 378742434 /nfs/dbraw/zinc/74/24/34/378742434.db2.gz WEDCAYLYDRQNMR-GFCCVEGCSA-N 0 3 295.814 2.600 10 70 CFIEHN CC[C@](C)(O)CN1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000161153057 378826548 /nfs/dbraw/zinc/82/65/48/378826548.db2.gz SDVMVONDOHTESA-QMMMGPOBSA-N 0 3 293.251 2.964 10 70 CFIEHN Cc1cccc([C@H](C)NCC(=O)N[C@H](C)C(C)C)c1 ZINC000160263311 322335784 /nfs/dbraw/zinc/33/57/84/322335784.db2.gz URBDGDRRLLYHCD-KGLIPLIRSA-N 0 3 262.397 2.806 10 70 CFIEHN O=C(NCCN1CCCCC1)[C@@H]1C[C@@H]1C1CCCCC1 ZINC000160572365 322340310 /nfs/dbraw/zinc/34/03/10/322340310.db2.gz BSPBFVBUAOOIME-HZPDHXFCSA-N 0 3 278.440 2.805 10 70 CFIEHN CCC[C@@H](C(=O)NCc1ccc(Cl)cc1)N(C)C ZINC000161135067 322347412 /nfs/dbraw/zinc/34/74/12/322347412.db2.gz OCAKGQDTSYACNO-ZDUSSCGKSA-N 0 3 268.788 2.687 10 70 CFIEHN CCC[C@@H](C(=O)N(C)CCOc1ccccc1C)N(C)C ZINC000161333650 322350408 /nfs/dbraw/zinc/35/04/08/322350408.db2.gz VMFJNXHQFNEGNM-HNNXBMFYSA-N 0 3 292.423 2.563 10 70 CFIEHN CCC[C@H](C(=O)NCc1ccc(C)cc1C)N(C)C ZINC000161478593 322352357 /nfs/dbraw/zinc/35/23/57/322352357.db2.gz POHRHDMLJRCIEO-OAHLLOKOSA-N 0 3 262.397 2.650 10 70 CFIEHN CCSCCN1CCC(c2cnn(CC)c2)CC1 ZINC000160055689 521706240 /nfs/dbraw/zinc/70/62/40/521706240.db2.gz VJXUTECTHKKLIS-UHFFFAOYSA-N 0 3 267.442 2.836 10 70 CFIEHN COCC1CCN(CCN(C)Cc2ccc(F)cc2)CC1 ZINC000159642688 522932759 /nfs/dbraw/zinc/93/27/59/522932759.db2.gz NAGWEYYYTFSLAB-UHFFFAOYSA-N 0 3 294.414 2.616 10 70 CFIEHN Fc1ccc(CN2CCC(c3cc[nH]n3)CC2)cc1 ZINC000160544492 526330658 /nfs/dbraw/zinc/33/06/58/526330658.db2.gz UORLPDUWJUMKBL-UHFFFAOYSA-N 0 3 259.328 2.928 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H](C)CCc1ccccc1)N(C)C ZINC000161170671 276021666 /nfs/dbraw/zinc/02/16/66/276021666.db2.gz WFRQEMSYXHGOQP-ZBFHGGJFSA-N 0 3 276.424 2.854 10 70 CFIEHN CCC[C@@H](C(=O)N(CC)Cc1ccccc1)N(C)C ZINC000161395681 278853828 /nfs/dbraw/zinc/85/38/28/278853828.db2.gz FVIWZZFYMQBLTI-HNNXBMFYSA-N 0 3 262.397 2.765 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H]1CCCc2ccccc21)N(C)C ZINC000160365923 322337056 /nfs/dbraw/zinc/33/70/56/322337056.db2.gz XLSBUBWQZJASDL-HZPDHXFCSA-N 0 3 274.408 2.911 10 70 CFIEHN O=C(NCCN1CCCCC1)[C@H]1C[C@@H]1C1CCCCC1 ZINC000160572166 322339941 /nfs/dbraw/zinc/33/99/41/322339941.db2.gz BSPBFVBUAOOIME-CVEARBPZSA-N 0 3 278.440 2.805 10 70 CFIEHN CCC[C@@H](C(=O)N1CCC[C@H](CC)CC1)N(C)C ZINC000160791403 322342787 /nfs/dbraw/zinc/34/27/87/322342787.db2.gz OOZWKOFUQSRLPN-KBPBESRZSA-N 0 3 254.418 2.755 10 70 CFIEHN CN(C)CCN(C)c1ccnc2c(F)cc(F)cc12 ZINC000159803204 521748192 /nfs/dbraw/zinc/74/81/92/521748192.db2.gz NHVUDLAQNIPIOT-UHFFFAOYSA-N 0 3 265.307 2.511 10 70 CFIEHN CCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccccc1C)CC2 ZINC000159604146 522528386 /nfs/dbraw/zinc/52/83/86/522528386.db2.gz HIPBWMXZMZEUSL-KGLIPLIRSA-N 0 3 284.407 2.815 10 70 CFIEHN COc1ccc([C@H](C)N[C@@H]2CCC[C@@H](O)C2)c(OC)c1 ZINC000217653905 539660931 /nfs/dbraw/zinc/66/09/31/539660931.db2.gz BDSOFBGVVRIOEH-YNEHKIRRSA-N 0 3 279.380 2.658 10 70 CFIEHN COc1ccc([C@H](C)N[C@H]2CCC[C@@H](O)C2)c(OC)c1 ZINC000217654052 539661654 /nfs/dbraw/zinc/66/16/54/539661654.db2.gz BDSOFBGVVRIOEH-RWMBFGLXSA-N 0 3 279.380 2.658 10 70 CFIEHN COc1ccc([C@H](C)N[C@@H]2CCC[C@@H](O)C2)c(F)c1 ZINC000218300602 539690042 /nfs/dbraw/zinc/69/00/42/539690042.db2.gz MYUJRCIRJNCCIV-QJPTWQEYSA-N 0 3 267.344 2.788 10 70 CFIEHN CCC[C@H](C(=O)NCCSc1ccccc1)N(C)C ZINC000161274994 378835203 /nfs/dbraw/zinc/83/52/03/378835203.db2.gz GBUILSMDGXJDPQ-CQSZACIVSA-N 0 3 280.437 2.625 10 70 CFIEHN CCCCNC(=O)[C@H](C)N[C@H](C)c1cccc(C)c1 ZINC000160226449 322334851 /nfs/dbraw/zinc/33/48/51/322334851.db2.gz KZBVDOGMHAMTFU-KGLIPLIRSA-N 0 3 262.397 2.950 10 70 CFIEHN Cc1cccc([C@H](C)NCC(=O)N[C@@H](C)C(C)C)c1 ZINC000160263181 322335554 /nfs/dbraw/zinc/33/55/54/322335554.db2.gz URBDGDRRLLYHCD-KBPBESRZSA-N 0 3 262.397 2.806 10 70 CFIEHN O=C(NCCN1CCCCC1)[C@H]1C[C@H]1C1CCCCC1 ZINC000160572059 322339686 /nfs/dbraw/zinc/33/96/86/322339686.db2.gz BSPBFVBUAOOIME-HOTGVXAUSA-N 0 3 278.440 2.805 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H](C)c1ccc(OC)c(F)c1)N(C)C ZINC000161284524 322350041 /nfs/dbraw/zinc/35/00/41/322350041.db2.gz SEYGJIZNGAVRJI-RISCZKNCSA-N 0 3 296.386 2.742 10 70 CFIEHN CCOCCN(CC)CCN(C)Cc1ccc(F)cc1 ZINC000159555091 519909344 /nfs/dbraw/zinc/90/93/44/519909344.db2.gz OYMMZTCSALCUGA-UHFFFAOYSA-N 0 3 282.403 2.616 10 70 CFIEHN CN(CCN(CC(F)F)C1CC1)Cc1ccc(F)cc1 ZINC000159544086 522819071 /nfs/dbraw/zinc/81/90/71/522819071.db2.gz WAECZMLYOKMZHI-UHFFFAOYSA-N 0 3 286.341 2.987 10 70 CFIEHN CCN1CCO[C@H](CNCc2c(C)oc3ccccc32)C1 ZINC000160792669 541479746 /nfs/dbraw/zinc/47/97/46/541479746.db2.gz QBMQATHWYOKHFH-CQSZACIVSA-N 0 3 288.391 2.552 10 70 CFIEHN CC[C@@](C)(O)CN1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000161153194 378826640 /nfs/dbraw/zinc/82/66/40/378826640.db2.gz SDVMVONDOHTESA-MRVPVSSYSA-N 0 3 293.251 2.964 10 70 CFIEHN CC[C@H](C(=O)N[C@H]1CC(C)(C)Oc2ccccc21)N(C)C ZINC000159551409 394365551 /nfs/dbraw/zinc/36/55/51/394365551.db2.gz NKBSRYRMJCCAFA-UONOGXRCSA-N 0 3 290.407 2.745 10 70 CFIEHN CCC[C@H](C(=O)NCc1ccc(Cl)cc1)N(C)C ZINC000161135200 322347723 /nfs/dbraw/zinc/34/77/23/322347723.db2.gz OCAKGQDTSYACNO-CYBMUJFWSA-N 0 3 268.788 2.687 10 70 CFIEHN CCc1csc([C@@H]2CCCN(CC(OC)OC)C2)n1 ZINC000160787691 522115074 /nfs/dbraw/zinc/11/50/74/522115074.db2.gz JHSOAYRQSJPZBL-LLVKDONJSA-N 0 3 284.425 2.504 10 70 CFIEHN Cc1nccn1C[C@@H]1CCCN1Cc1cnc2ccccn12 ZINC000160964304 527441393 /nfs/dbraw/zinc/44/13/93/527441393.db2.gz BHWLRHBMOSWVDJ-HNNXBMFYSA-N 0 3 295.390 2.504 10 70 CFIEHN CCn1cc(C2CCN(CCOCC3CC3)CC2)cn1 ZINC000160055214 232246938 /nfs/dbraw/zinc/24/69/38/232246938.db2.gz RAAULGRSBZGOCZ-UHFFFAOYSA-N 0 3 277.412 2.509 10 70 CFIEHN COc1ccc(C)cc1[C@H](C)N[C@H]1CCC[C@@H](O)C1 ZINC000217660387 539661975 /nfs/dbraw/zinc/66/19/75/539661975.db2.gz OTHPCMNCILZLNT-MELADBBJSA-N 0 3 263.381 2.958 10 70 CFIEHN CN(Cc1ccc2ccccc2n1)C[C@@H]1CCC[C@@H]1O ZINC000159476721 378712116 /nfs/dbraw/zinc/71/21/16/378712116.db2.gz IJCRDYVQQNVRMV-YOEHRIQHSA-N 0 3 270.376 2.828 10 70 CFIEHN COc1ccc(F)cc1CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160764646 378796105 /nfs/dbraw/zinc/79/61/05/378796105.db2.gz ATPUDECIFUPWSN-RHSMWYFYSA-N 0 3 293.382 2.961 10 70 CFIEHN CCC[C@@H](C(=O)NCc1ccccc1Cl)N(C)C ZINC000161173491 378827139 /nfs/dbraw/zinc/82/71/39/378827139.db2.gz WTRZLHBELJHHQA-ZDUSSCGKSA-N 0 3 268.788 2.687 10 70 CFIEHN CC(C)C[C@H](CN(C)C)NC(=O)N1CCC2(CCC2)C1 ZINC000160813009 279123085 /nfs/dbraw/zinc/12/30/85/279123085.db2.gz KLLMYVLPETZZCU-CQSZACIVSA-N 0 3 281.444 2.548 10 70 CFIEHN Cc1cccc([C@H](C)NC[C@@H](O)COC(C)(C)C)c1 ZINC000160264996 322335780 /nfs/dbraw/zinc/33/57/80/322335780.db2.gz RWNRDJMRKQIXCG-DZGCQCFKSA-N 0 3 265.397 2.822 10 70 CFIEHN O[C@@]12CCCC[C@@H]1CN(CCOc1cccc(F)c1)CC2 ZINC000160771940 322342887 /nfs/dbraw/zinc/34/28/87/322342887.db2.gz SVHSZFVJBZVBOX-RHSMWYFYSA-N 0 3 293.382 2.832 10 70 CFIEHN CCC[C@@H](C(=O)NCCc1cccc(Cl)c1)N(C)C ZINC000161258477 322349279 /nfs/dbraw/zinc/34/92/79/322349279.db2.gz VVWXYXZVPUELPY-AWEZNQCLSA-N 0 3 282.815 2.729 10 70 CFIEHN CN(CCOCC1CC1)CCN(C)Cc1ccc(F)cc1 ZINC000160125488 522892724 /nfs/dbraw/zinc/89/27/24/522892724.db2.gz UDIFJWNPFRJXAP-UHFFFAOYSA-N 0 3 294.414 2.616 10 70 CFIEHN COc1cccc(CN2CCC(c3ccnn3C)CC2)c1 ZINC000160651807 525934090 /nfs/dbraw/zinc/93/40/90/525934090.db2.gz AQJRKQXJXYSUHW-UHFFFAOYSA-N 0 3 285.391 2.808 10 70 CFIEHN CCN1CCO[C@@H](CN[C@H](C)c2ccc(Cl)cc2)C1 ZINC000159984071 348015126 /nfs/dbraw/zinc/01/51/26/348015126.db2.gz DYZDMQHUXSETJR-DOMZBBRYSA-N 0 3 282.815 2.711 10 70 CFIEHN CC(C)OC(=O)NCCCN(C)Cc1ccccc1 ZINC000160327753 378763384 /nfs/dbraw/zinc/76/33/84/378763384.db2.gz QAEWCDOIBJJJBA-UHFFFAOYSA-N 0 3 264.369 2.643 10 70 CFIEHN C[C@H]1C[C@@H](NC[C@@H]2CN(C)CCO2)c2ccsc2S1 ZINC000217001347 393755814 /nfs/dbraw/zinc/75/58/14/393755814.db2.gz HNOKDQHVVDLIJJ-DMDPSCGWSA-N 0 3 298.477 2.594 10 70 CFIEHN Cc1cccc([C@@H](C)NC[C@@H](O)COC(C)(C)C)c1 ZINC000160240503 322335344 /nfs/dbraw/zinc/33/53/44/322335344.db2.gz RWNRDJMRKQIXCG-UKRRQHHQSA-N 0 3 265.397 2.822 10 70 CFIEHN CCC[C@H](C(=O)NCCOc1ccc(Cl)cc1)N(C)C ZINC000161268986 322349671 /nfs/dbraw/zinc/34/96/71/322349671.db2.gz VWAIGMILOPAFGN-CQSZACIVSA-N 0 3 298.814 2.565 10 70 CFIEHN CN(CCN1CCOCC12CCC2)Cc1ccc(F)cc1 ZINC000160937395 522839622 /nfs/dbraw/zinc/83/96/22/522839622.db2.gz XJABCZVTMQUANR-UHFFFAOYSA-N 0 3 292.398 2.512 10 70 CFIEHN Cc1nc(CCN2C[C@H]3CCCCN3C[C@@H]2C)cs1 ZINC000218133575 526813083 /nfs/dbraw/zinc/81/30/83/526813083.db2.gz PTUIRIWDHJORTB-SWLSCSKDSA-N 0 3 279.453 2.553 10 70 CFIEHN CCC[C@@H](C(=O)N[C@H]1CCCc2sccc21)N(C)C ZINC000159982371 378742626 /nfs/dbraw/zinc/74/26/26/378742626.db2.gz DBKPFCCIOSTALI-STQMWFEESA-N 0 3 280.437 2.972 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H](C)c1ccc(F)cc1F)N(C)C ZINC000161246604 378832431 /nfs/dbraw/zinc/83/24/31/378832431.db2.gz REWOOSNNCGLANI-IINYFYTJSA-N 0 3 284.350 2.872 10 70 CFIEHN CCC[C@@H](C(=O)N(CC)Cc1cccs1)N(C)C ZINC000161444967 378847935 /nfs/dbraw/zinc/84/79/35/378847935.db2.gz SLBOZXAUDVNRNC-ZDUSSCGKSA-N 0 3 268.426 2.827 10 70 CFIEHN CCC[C@@H](C(=O)NCc1ccccc1COCC)N(C)C ZINC000161498455 378850710 /nfs/dbraw/zinc/85/07/10/378850710.db2.gz MDKXRAFZZHAEDT-INIZCTEOSA-N 0 3 292.423 2.570 10 70 CFIEHN CCC[C@H](C(=O)NCC1(c2ccccc2)CC1)N(C)C ZINC000161355854 273619960 /nfs/dbraw/zinc/61/99/60/273619960.db2.gz LECIREMECNPJRU-OAHLLOKOSA-N 0 3 274.408 2.565 10 70 CFIEHN Cc1cccc([C@@H](C)NCC(=O)N[C@H](C)C(C)C)c1 ZINC000160238822 322335041 /nfs/dbraw/zinc/33/50/41/322335041.db2.gz URBDGDRRLLYHCD-ZIAGYGMSSA-N 0 3 262.397 2.806 10 70 CFIEHN CCCCNC(=O)[C@@H](C)N[C@@H](C)c1cccc(C)c1 ZINC000160251934 322335301 /nfs/dbraw/zinc/33/53/01/322335301.db2.gz KZBVDOGMHAMTFU-UONOGXRCSA-N 0 3 262.397 2.950 10 70 CFIEHN CC(C)C[C@H](CN(C)C)NC(=O)c1cnc(C(C)C)s1 ZINC000160363840 322336854 /nfs/dbraw/zinc/33/68/54/322336854.db2.gz HYXVIQJDDTULSO-GFCCVEGCSA-N 0 3 297.468 2.973 10 70 CFIEHN CCC[C@H](C(=O)N1CCC[C@H](CC)CC1)N(C)C ZINC000160791524 322342832 /nfs/dbraw/zinc/34/28/32/322342832.db2.gz OOZWKOFUQSRLPN-UONOGXRCSA-N 0 3 254.418 2.755 10 70 CFIEHN CCN1CCC[C@@H](NC(=O)c2ccc(F)c(SC)c2)C1 ZINC000160989287 322345836 /nfs/dbraw/zinc/34/58/36/322345836.db2.gz LTDRACMYGRJGMB-GFCCVEGCSA-N 0 3 296.411 2.762 10 70 CFIEHN COc1c(CNC[C@@H]2CCC[C@H](C)C2)c(C)nn1C ZINC000218238160 521834216 /nfs/dbraw/zinc/83/42/16/521834216.db2.gz TWZKONKHZPJMSC-WCQYABFASA-N 0 3 265.401 2.653 10 70 CFIEHN CCc1nc2n(n1)C[C@H](N[C@H](C)c1ccccc1C)CC2 ZINC000159604004 522534201 /nfs/dbraw/zinc/53/42/01/522534201.db2.gz HIPBWMXZMZEUSL-ZIAGYGMSSA-N 0 3 284.407 2.815 10 70 CFIEHN CN(CCN1CCOC2(CCC2)C1)Cc1ccc(F)cc1 ZINC000161312413 522834340 /nfs/dbraw/zinc/83/43/40/522834340.db2.gz FWLGWFFOGLBKNH-UHFFFAOYSA-N 0 3 292.398 2.512 10 70 CFIEHN COc1ccc(OC)c([C@H](C)N[C@H]2CCC[C@@H](O)C2)c1 ZINC000217662787 539661635 /nfs/dbraw/zinc/66/16/35/539661635.db2.gz BXIRGJYVOJQMOA-RWMBFGLXSA-N 0 3 279.380 2.658 10 70 CFIEHN CCCN(CC(=O)Nc1ccccc1C)C[C@](C)(O)CC ZINC000160462823 378774519 /nfs/dbraw/zinc/77/45/19/378774519.db2.gz KGTSYYHKFLSFDH-QGZVFWFLSA-N 0 3 292.423 2.807 10 70 CFIEHN COc1ccc(F)cc1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160764796 378796156 /nfs/dbraw/zinc/79/61/56/378796156.db2.gz ATPUDECIFUPWSN-PBHICJAKSA-N 0 3 293.382 2.961 10 70 CFIEHN CCC[C@@H](C(=O)N[C@@H](C)CCc1ccccc1)N(C)C ZINC000161170436 276268901 /nfs/dbraw/zinc/26/89/01/276268901.db2.gz WFRQEMSYXHGOQP-HOCLYGCPSA-N 0 3 276.424 2.854 10 70 CFIEHN CCc1csc([C@H]2CCCN(CC(OC)OC)C2)n1 ZINC000160787813 522115789 /nfs/dbraw/zinc/11/57/89/522115789.db2.gz JHSOAYRQSJPZBL-NSHDSACASA-N 0 3 284.425 2.504 10 70 CFIEHN CSc1ccc(C(=O)NC[C@H]2CCCN2CC(C)C)o1 ZINC000160523322 378778543 /nfs/dbraw/zinc/77/85/43/378778543.db2.gz LGPHZLIIJVCPLV-GFCCVEGCSA-N 0 3 296.436 2.852 10 70 CFIEHN CCC[C@H](C(=O)N(CC)Cc1ccccc1)N(C)C ZINC000161395820 378844516 /nfs/dbraw/zinc/84/45/16/378844516.db2.gz FVIWZZFYMQBLTI-OAHLLOKOSA-N 0 3 262.397 2.765 10 70 CFIEHN CCC(C)(C)NC(=O)CN[C@@H](C)c1cccc(C)c1 ZINC000160252890 322334982 /nfs/dbraw/zinc/33/49/82/322334982.db2.gz ZHJYBLCZAFNZNT-ZDUSSCGKSA-N 0 3 262.397 2.950 10 70 CFIEHN CCC[C@H](C(=O)N[C@H](C)CCc1ccccc1)N(C)C ZINC000161170794 276039027 /nfs/dbraw/zinc/03/90/27/276039027.db2.gz WFRQEMSYXHGOQP-GDBMZVCRSA-N 0 3 276.424 2.854 10 70 CFIEHN CCN(CC)CC(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000159989757 276094784 /nfs/dbraw/zinc/09/47/84/276094784.db2.gz FWNDLKZSKKXROB-CQSZACIVSA-N 0 3 290.407 2.747 10 70 CFIEHN Cc1cccc([C@H](C)NC[C@H](O)COC(C)(C)C)c1 ZINC000160264865 322335771 /nfs/dbraw/zinc/33/57/71/322335771.db2.gz RWNRDJMRKQIXCG-ZFWWWQNUSA-N 0 3 265.397 2.822 10 70 CFIEHN CCC[C@H](C(=O)NC[C@@H]1CCCc2ccccc21)N(C)C ZINC000161454456 322351722 /nfs/dbraw/zinc/35/17/22/322351722.db2.gz ANECPSXBYAACAK-DOTOQJQBSA-N 0 3 288.435 2.953 10 70 CFIEHN CC(C)n1cncc1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160775289 520054666 /nfs/dbraw/zinc/05/46/66/520054666.db2.gz DKOVIOZWGUXQPM-ZBFHGGJFSA-N 0 3 277.412 2.591 10 70 CFIEHN CC(C)n1cncc1CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160775160 520056054 /nfs/dbraw/zinc/05/60/54/520056054.db2.gz DKOVIOZWGUXQPM-GDBMZVCRSA-N 0 3 277.412 2.591 10 70 CFIEHN COc1ccc(CN2CCC(c3cc[nH]n3)CC2)cc1 ZINC000160536163 524024997 /nfs/dbraw/zinc/02/49/97/524024997.db2.gz QQDCIGXCXIGTSN-UHFFFAOYSA-N 0 3 271.364 2.798 10 70 CFIEHN Cn1nccc1C1CCN(Cc2ccccc2F)CC1 ZINC000160525749 527599743 /nfs/dbraw/zinc/59/97/43/527599743.db2.gz RLASWIQEEWDKQH-UHFFFAOYSA-N 0 3 273.355 2.939 10 70 CFIEHN CCC[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N(C)C ZINC000161181822 378829115 /nfs/dbraw/zinc/82/91/15/378829115.db2.gz RUHRWSONGSPPEE-INIZCTEOSA-N 0 3 287.407 2.557 10 70 CFIEHN CCC[C@@H](C(=O)NCC1(c2ccccc2)CC1)N(C)C ZINC000161355738 276269035 /nfs/dbraw/zinc/26/90/35/276269035.db2.gz LECIREMECNPJRU-HNNXBMFYSA-N 0 3 274.408 2.565 10 70 CFIEHN CCC(C)(C)NC(=O)CN[C@H](C)c1cccc(C)c1 ZINC000160227285 322334804 /nfs/dbraw/zinc/33/48/04/322334804.db2.gz ZHJYBLCZAFNZNT-CYBMUJFWSA-N 0 3 262.397 2.950 10 70 CFIEHN CCC[C@@H](C(=O)NCCOc1ccc(Cl)cc1)N(C)C ZINC000161268862 322349727 /nfs/dbraw/zinc/34/97/27/322349727.db2.gz VWAIGMILOPAFGN-AWEZNQCLSA-N 0 3 298.814 2.565 10 70 CFIEHN CCn1nc(C)c([C@H](C)NCC2(CO)CCCC2)c1C ZINC000160112720 523663545 /nfs/dbraw/zinc/66/35/45/523663545.db2.gz XHWZREXRTMJCCZ-LBPRGKRZSA-N 0 3 279.428 2.723 10 70 CFIEHN Cc1cccc([C@H](C)N[C@@H](C)C(=O)NCC(C)C)c1 ZINC000160251258 524874052 /nfs/dbraw/zinc/87/40/52/524874052.db2.gz VEBTVXCHZWQWSD-KBPBESRZSA-N 0 3 262.397 2.806 10 70 CFIEHN Cc1nc(C[C@@H]2CCCN(Cc3cccc(F)c3)C2)no1 ZINC000161047373 526919264 /nfs/dbraw/zinc/91/92/64/526919264.db2.gz CRGXOYVLYDBKTL-AWEZNQCLSA-N 0 3 289.354 2.972 10 70 CFIEHN CC[C@@](C)(O)CN(C)Cc1ccccc1N1CCCC1 ZINC000160342647 378765278 /nfs/dbraw/zinc/76/52/78/378765278.db2.gz WKYCMBALGDENFA-QGZVFWFLSA-N 0 3 276.424 2.880 10 70 CFIEHN CC[C@](C)(O)CN(C)Cc1ccccc1N1CCCC1 ZINC000160342535 378765507 /nfs/dbraw/zinc/76/55/07/378765507.db2.gz WKYCMBALGDENFA-KRWDZBQOSA-N 0 3 276.424 2.880 10 70 CFIEHN CCC[C@@H](C(=O)NCc1cccc(Cl)c1)N(C)C ZINC000161173863 378827243 /nfs/dbraw/zinc/82/72/43/378827243.db2.gz BGGATUADIGLIDW-ZDUSSCGKSA-N 0 3 268.788 2.687 10 70 CFIEHN CCC[C@H](C(=O)NCc1ccccc1Cl)N(C)C ZINC000161173593 378828332 /nfs/dbraw/zinc/82/83/32/378828332.db2.gz WTRZLHBELJHHQA-CYBMUJFWSA-N 0 3 268.788 2.687 10 70 CFIEHN CC(C)N1C[C@H](NC(=O)c2cccc3cc[nH]c32)[C@@H](C)C1 ZINC000161342237 378841702 /nfs/dbraw/zinc/84/17/02/378841702.db2.gz QXARSRFMPXZCRS-WFASDCNBSA-N 0 3 285.391 2.626 10 70 CFIEHN CCC[C@H](C(=O)NCCc1cc2ccccc2[nH]1)N(C)C ZINC000161445146 322351902 /nfs/dbraw/zinc/35/19/02/322351902.db2.gz MFUYOZLNRCWIPN-MRXNPFEDSA-N 0 3 287.407 2.557 10 70 CFIEHN CCC[C@@H](C(=O)NC[C@H]1CCCc2ccccc21)N(C)C ZINC000161454594 322352101 /nfs/dbraw/zinc/35/21/01/322352101.db2.gz ANECPSXBYAACAK-WBVHZDCISA-N 0 3 288.435 2.953 10 70 CFIEHN COc1c(CNC[C@H]2CCC[C@@H](C)C2)c(C)nn1C ZINC000218238091 521833040 /nfs/dbraw/zinc/83/30/40/521833040.db2.gz TWZKONKHZPJMSC-YPMHNXCESA-N 0 3 265.401 2.653 10 70 CFIEHN CCn1cnnc1[C@@H]1CCCN(CCOCCC(C)C)C1 ZINC000161411939 523596507 /nfs/dbraw/zinc/59/65/07/523596507.db2.gz VRLCXIPDAAROMQ-OAHLLOKOSA-N 0 3 294.443 2.540 10 70 CFIEHN CCN1CCC[C@H]1CN(C)C(=O)c1ccc(Cl)nc1C ZINC000159999598 378742555 /nfs/dbraw/zinc/74/25/55/378742555.db2.gz WEDCAYLYDRQNMR-LBPRGKRZSA-N 0 3 295.814 2.600 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H](C)c1ccccc1C)N(C)C ZINC000161241637 378833128 /nfs/dbraw/zinc/83/31/28/378833128.db2.gz MMDWIPSXLWZWOV-DZGCQCFKSA-N 0 3 262.397 2.903 10 70 CFIEHN CCC[C@@H](C(=O)NCc1ccc(COCC)cc1)N(C)C ZINC000161495655 378851436 /nfs/dbraw/zinc/85/14/36/378851436.db2.gz NCAKSYWRPRPHOR-INIZCTEOSA-N 0 3 292.423 2.570 10 70 CFIEHN C[C@H]1C[C@H](NC[C@@H]2CN(C)CCO2)c2ccsc2S1 ZINC000217001336 278497861 /nfs/dbraw/zinc/49/78/61/278497861.db2.gz HNOKDQHVVDLIJJ-LOWVWBTDSA-N 0 3 298.477 2.594 10 70 CFIEHN CC[C@H](C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21)N(C)C ZINC000159551159 280683717 /nfs/dbraw/zinc/68/37/17/280683717.db2.gz NKBSRYRMJCCAFA-ZIAGYGMSSA-N 0 3 290.407 2.745 10 70 CFIEHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)C1CCC(C)(C)CC1 ZINC000160386571 322337588 /nfs/dbraw/zinc/33/75/88/322337588.db2.gz MKWPZCBTNZVOKZ-DZGCQCFKSA-N 0 3 278.440 2.898 10 70 CFIEHN Cc1nc(C[C@H]2CCCN(Cc3ccccc3)C2)no1 ZINC000161045610 526922889 /nfs/dbraw/zinc/92/28/89/526922889.db2.gz LNCXYOGBDZPTJA-OAHLLOKOSA-N 0 3 271.364 2.833 10 70 CFIEHN CCC[C@H](C(=O)N[C@@H]1CCCc2sccc21)N(C)C ZINC000159982242 378741507 /nfs/dbraw/zinc/74/15/07/378741507.db2.gz DBKPFCCIOSTALI-CHWSQXEVSA-N 0 3 280.437 2.972 10 70 CFIEHN